3254-0177 Screening compound: (E)-N-{4-[(2-chlorophenyl)methyl]piperazin-1-yl}-1-(5-methylthiophen-2-yl)methanimine

3254-0177 Screening compound: (E)-N-{4-[(2-chlorophenyl)methyl]piperazin-1-yl}-1-(5-methylthiophen-2-yl)methanimine
3254-0177 Screening compound: (E)-N-{4-[(2-chlorophenyl)methyl]piperazin-1-yl}-1-(5-methylthiophen-2-yl)methanimine alternative view

Chemical Structure Depiction of ChemDiv screening compound 3254-0177
(E)-N-{4-[(2-chlorophenyl)methyl]piperazin-1-yl}-1-(5-methylthiophen-2-yl)methanimine

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

3254-0177

Molecular Formula

C17H20ClN3S (C17 H20 ClN3 S)

Compound Name

(E)-N-{4-[(2-chlorophenyl)methyl]piperazin-1-yl}-1-(5-methylthiophen-2-yl)methanimine

IUPAC name

(E)-N-{4-[(2-chlorophenyl)methyl]piperazin-1-yl}-1-(5-methylthiophen-2-yl)methanimine

SMILES

Cc1ccc(/C=N/N2CCN(Cc(cccc3)c3Cl)CC2)s1

InChI

InChI=1S/C17H20ClN3S/c1-14-6-7-16(22-14)12-19-21-10-8-20(9-11-21)13-15-4-2-3-5-17(15)18/h2-7,12H,8-11,13H2,1H3

InChI Key

IMIGDSCNHUFAJZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02076455

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

333.88

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.361

Distribution Coefficient, logD

4.290

Water Solubility, LogSw

-4.34

Polar Surface Area

17.864

Acid Dissociation Constant (pKa)

24.09

Base Dissociation Constant (pKb)

6.65

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.30

References: we are preparing a list of scientific research reports with 3254-0177 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3254-0177?
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What is the minimum amount of 3254-0177 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3254-0177
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3254-0177
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of 3254-0177 available by request